IBS-ZINC02127268 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 0.6520 -0.2580 1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -0.0890 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -0.8510 -1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -0.6420 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 -0.3480 -1.3800 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4400 -0.7630 -2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4200 -0.9760 -1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3980 -0.2850 -1.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 1.1010 -1.5590 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 1.6240 -2.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 0.8950 -3.7680 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3670 3.1140 -2.9830 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5060 3.6100 -2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 3.6050 -2.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4200 3.4270 -4.4130 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4180 2.9130 -5.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 3.1430 -6.4500 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6490 3.9280 -7.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 4.1770 -8.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 4.9800 -9.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 5.5480 -8.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 5.3170 -7.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 4.5080 -6.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 4.2310 -4.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 4.7030 -4.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 0.0550 1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 0.3540 2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -1.3050 1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 0.9690 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 -1.9090 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -0.7300 -2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8960 -0.4570 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -1.7190 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9610 -0.1680 0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 1.6840 -0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6080 3.3720 -1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7390 4.6830 -2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5090 3.1090 -2.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1530 2.2800 -4.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 3.7400 -9.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 5.1710 -10.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 6.1750 -8.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 5.7610 -6.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5530 -2.3040 -1.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 -2.6610 -1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 44 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 44 45 1 0 0 0 0 M END